1-(2-methoxyethyl)-6-oxidanylidene-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide

Systemtic Name: 1-(2-methoxyethyl)-6-oxidanylidene-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide Openeye Name: 1-(2-methoxyethyl)-6-oxo-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide CAS Name: 1-(2-methoxyethyl)-6-oxo-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]-3-pyridazinecarboxamide IUPAC Name: 1-(2-methoxyethyl)-6-oxo-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]pyridazine-3-carboxamide Traditional Name: 6-keto-1-(2-methoxyethyl)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]pyridazine-3-carboxamide Formula: C21H29N4O3+ MolecularWeight: 385.47996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C=CC(=N1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

COCCN1C(=O)C=CC(=N1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C21H28N4O3/c1-28-14-13-25-20(26)10-9-19(23-25)21(27)22-15-17-5-7-18(8-6-17)16-24-11-3-2-4-12-24/h5-10H,2-4,11-16H2,1H3,(H,22,27)/p+1